4-(1H-indol-3-yl)-1-[1-methyl-3-(4-methyl-4H-1,2,4-triazol-3-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]butan-1-one
Chemical Structure Depiction of
4-(1H-indol-3-yl)-1-[1-methyl-3-(4-methyl-4H-1,2,4-triazol-3-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]butan-1-one
4-(1H-indol-3-yl)-1-[1-methyl-3-(4-methyl-4H-1,2,4-triazol-3-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]butan-1-one
Compound characteristics
| Compound ID: | S565-1226 |
| Compound Name: | 4-(1H-indol-3-yl)-1-[1-methyl-3-(4-methyl-4H-1,2,4-triazol-3-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]butan-1-one |
| Molecular Weight: | 403.49 |
| Molecular Formula: | C22 H25 N7 O |
| Smiles: | Cn1cnnc1c1c2CN(CCc2n(C)n1)C(CCCc1c[nH]c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2051 |
| logD: | 1.1999 |
| logSw: | -2.1569 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.822 |
| InChI Key: | NQTZOIIQHOIOSW-UHFFFAOYSA-N |